1JXZ
Structure of the H90Q mutant of 4-Chlorobenzoyl-Coenzyme A Dehalogenase complexed with 4-hydroxybenzoyl-Coenzyme A (product)
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C (A, B, C) | 4-chlorobenzoyl Coenzyme A dehalogenase | polymer | 269 | 29888.5 | 3 | PIR (419529) Pfam (PF00378) UniProt (by SIFTS) (A5JTM5) | Pseudomonas sp. CBS3 | 4-chlorobenzoate dehalogenase |
| 2 | D, F, I (A, B, C) | CALCIUM ION | non-polymer | 40.1 | 3 | Chemie (CA) | |||
| 3 | E, H, J (A, B, C) | 4-HYDROXYBENZOYL COENZYME A | non-polymer | 887.6 | 3 | Chemie (BCA) | |||
| 4 | G (B) | PHOSPHATE ION | non-polymer | 95.0 | 1 | Chemie (PO4) | |||
| 5 | K, L, M (A, B, C) | water | water | 18.0 | 796 | Chemie (HOH) |
Sequence modifications
A, B, C: 1 - 269 (PIR: 419529)
| PDB | External Database | Details |
|---|---|---|
| Ala 85 | Gly 85 | conflict |
| Gln 90 | His 90 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 89665.4 | |
| Non-Polymers* | Number of molecules | 7 |
| Total formula weight | 2878.1 | |
| All* | Total formula weight | 92543.5 |
